Compound Detail
CHEMBL4786158
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Basic Information
| ChEMBL ID | CHEMBL4786158 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WRMTZTQHCDVWNR-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
473.5
MW (Da)
4.51
ALogP
5
HBA
2
HBD
79.3
PSA (Ų)
0.58
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 9.24
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Transient receptor potential cation channel subfamily V member 1 CHEMBL4794 | Ki | 9.24 | 8.915 | 0.6 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Transient receptor potential cation channel subfamily V member 1 | Ki | = | 0.57 | nM | 9.24 | Displacement of [3H]RTX from human TRPV1 expressed in CHO cells | 33385210 |
| Transient receptor potential cation channel subfamily V member 1 | Ki | = | 2.59 | nM | 8.59 | Antagonist activity at human TRPV1 expressed in CHO cells assessed as inhibition... | 33385210 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 33385210 | 10.1021/acs.jmedchem.0c00982 | Transient receptor potential cation channel subfamily V member 1 | 3 |
Data from ChEMBL 36 via Core Engine